Chemical ID: 6347629

Cc1c(sc(n1)NC(=O)COc2ccc3ccccc3c2)C
Chemical ID:
6347629
Name [?]:
N-(4,5-dimethylthiazol-2-yl)-2-(2-naphthyloxy)acetamide
SMILES [?]:
Cc1c(sc(n1)NC(=O)COc2ccc3ccccc3c2)C
InChi [?]:
InChI=1/C17H16N2O2S/c1-11-12(2)22-17(18-11)19-16(20)10-21-15-8-7-13-5-3-4-6-14(13)9-15/h3-9H,10H2,1-2H3,(H,18,19,20)
InChi Info:
AuxInfo=1/1/N:1,22,17,18,16,19,14,13,21,10,2,3,15,20,12,8,5,6,7,9,11,4/rA:22nCCCSCNNCOCOCCCCCCCCCCC/rB:s1;d2;s3;s4;s2d5;s5;s7;d8;s8;s10;s11;s12;d13;s14;s15;d16;s17;d18;d15s19;d12s20;s3;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H16N2O2S
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:7.98073
Area:517.923
Solvation:-4.96734
Coulombic:-33.1631
Bond Count [?]
All:24
Single:16
Double:8
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:312.387
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.91
LogP (Chemaxon):3.3

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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